⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL13923814 | 0.81 | — | — | |
| SCHEMBL13923813 | 0.81 | — | — | |
| SCHEMBL2284844 | 0.76 | — | — | |
| SCHEMBL12914467 | 0.74 | — | — | |
| SCHEMBL11668754 | 0.74 | — | — | |
| SCHEMBL11565524 | 0.72 | — | — | |
| SCHEMBL12377368 | 0.71 | — | — | |
| SCHEMBL2363205 | 0.71 | — | — | |
| SCHEMBL21679572 | 0.71 | — | — | |
| SCHEMBL6765161 | 0.71 | — | — |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-101076752-B | Composite contact lens and production method for lens material | HOYA CORP | 2012-02-29 | — | — | CN | disclosed |
| CN-101076752-A | Composite contact lens and production method for lens material | HOYA HEALTHCARE CORP (JP) | 2007-11-21 | — | — | CN | disclosed |
| US-4177322-A | ENCAPPED POLYSILOXANE | DOW CORNING CORPORATION (US) | 1979-12-04 | — | — | US | disclosed |